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canSAR1201763
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NAMES
    SMILES
    CN/C(=N\C#N)NCCCCNc1ccccn1
    InChI
    InChI=1S/C12H18N6/c1-14-12(18-10-13)17-9-5-4-8-16-11-6-2-3-7-15-11/h2-3,6-7H,4-5,8-9H2,1H3,(H,15,16)(H2,14,17,18)
    MOLECULAR FORMULA
    C12H18N6
    CROSS REFERENCES
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    canSAR1201763

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 246.16
    AlogP 0.92
    HBond donors 3
    HBond acceptors 6
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1201763.